UCSF

ZINC33671800

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2009 39 No

Popular Name: (4E,5S)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-5-(4-isopentyloxy-3-methoxy-phenyl)-1-phenethyl-p (4E,5S)-4-[(2,5-dimethylphenyl)-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.31 16.27 -43 0 6 -1 79 526.653 11 ↓
Lo Low (pH 4.5-6) 6.31 15.13 -18.79 1 6 0 76 527.661 11 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )